SCHEMBL20985

SCHEMBL20985

COc1cc(Nc2nc3c(-c4ccc(C(N)=O)cc4)nccn3n2)cc(OC)c1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ZAP70 P43403 13/20 0.48
KARS1 Q15046 12/20 0.48
JAK2 O60674 3/20 0.48
SYK P43405 5/20 0.46
MAPK8 P45983 1/20 0.42
CAMKK2 Q96RR4 1/20 0.42
JAK3 P52333 2/20 0.42
PLAU P00749 1/20 0.42
PTK2 Q05397 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL20535 0.90 SYK (0.48) ZAP70KARS1JAK2SYKJAK3
SCHEMBL19086 0.88 JAK2 (0.47) ZAP70JAK2SYKJAK3PTK2
SCHEMBL19799 0.87 JAK2 (0.43) ZAP70KARS1JAK2SYKJAK3
SCHEMBL20897 0.87 MKNK1 (0.48) JAK2SYKMAPK8CAMKK2JAK3
SCHEMBL15207207 0.86 FLT1 (0.45) ZAP70JAK2SYKJAK3PTK2
SCHEMBL19738 0.84 KDR (0.53) JAK2SYKJAK3PTK2
SCHEMBL21584 0.84 FLT1 (0.44) ZAP70KARS1JAK2SYKJAK3
SCHEMBL15207893 0.82 SYK (0.43) ZAP70KARS1JAK2SYKJAK3
SCHEMBL15208123 0.82 JAK2 (0.41) ZAP70KARS1JAK2SYKJAK3
SCHEMBL19105 0.81 MAPK8 (0.55) JAK2MAPK8CAMKK2JAK3

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP claimed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US claimed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US claimed
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
EP-2609098-B1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2016-07-13 EP disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-9023851-B2 Triazolopyrazine derivatives MERCK PATENT GMBH (DE) 2015-05-05 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609098-A1 TRIAZOLOPYRAZINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed
WO-2012025186-A1 TRIAZOLOPYRAZINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130225568-A1 TRIAZOLOPYRAZINE DERIVATIVES SYK, IRAK1, ZAP70 ZAP70 3/4885KARS1 483/4885JAK2 5/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.